SCHEMBL21992574

SCHEMBL21992574

COC(=O)C(C)C(C)Oc1ccc(F)c(OC)c1

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
GAA P10253 1/20 0.41
MAPT P10636 1/20 0.41
HTT P42858 1/20 0.40
TAS1R3 Q7RTX0 1/20 0.40
TAS1R1 Q7RTX1 1/20 0.40
TAS1R2 Q8TE23 1/20 0.40
BACE1 P56817 2/20 0.39
TP53 P04637 1/20 0.39
POLB P06746 1/20 0.39
GRM4 Q14833 1/20 0.39

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL21991810 0.89 TDP1 (0.42) MEN1KMT2AGAAMAPTTAS1R3
SCHEMBL21991269 0.87 TAS2R14 (0.38) BACE1
SCHEMBL21991268 0.87 APP (0.44) MEN1KMT2AGAAMAPTHTT
SCHEMBL23606004 0.85 POLB (0.46) MEN1KMT2AGAAMAPTHTT
SCHEMBL21991992 0.81 PARP15 (0.39) BACE1TP53
SCHEMBL21991774 0.80 ALDH1A1 (0.53) MEN1KMT2AGAAMAPTTP53
SCHEMBL21992562 0.79 TAS1R3 (0.51) MEN1KMT2AGAAHTTTAS1R3
SCHEMBL21991931 0.79 BACE1 (0.40) MEN1KMT2AGAAMAPTBACE1
SCHEMBL24305884 0.77 CA12 (0.42) MEN1KMT2AGAAMAPTGRM4
SCHEMBL21991347 0.77 FFAR1 (0.39)

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220409566-A1 CCL5 Inhibitors LAPKO INC, dba AFECTA PHARMACEUTICALS 2022-12-29 US disclosed
US-20220142961-A1 CCL5 Inhibitors LAPKO INC, dba AFECTA PHARMACEUTICALS 2022-05-12 US disclosed
US-11318111-B2 CCL5 inhibitors LAPKO INC (US) 2022-05-03 US disclosed
US-20210196665-A1 CCL5 Inhibitors AFECTA PHARMACEUTICALS, INC. (US) 2021-07-01 US disclosed
US-10940132-B2 CCL5 inhibitors AFECTA PHARMACEUTICALS, INC. (US) 2021-03-09 US disclosed
US-20200138766-A1 CCL5 INHIBITORS LAPKO INC. DBA AFECTA PHARMACEUTICALS 2020-05-07 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (6 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20220142961-A1 CCL5 Inhibitors CCL5, CCL11, CCR5 MEN1 3749/4885KMT2A 4842/4885GAA 2392/4885
US-20200138766-A1 CCL5 INHIBITORS CCL5, CCL11, CCR5 MEN1 3749/4885KMT2A 4842/4885GAA 2392/4885
US-20210196665-A1 CCL5 Inhibitors CCL5, CCL11, CCR5 MEN1 3749/4885KMT2A 4842/4885GAA 2392/4885
US-10940132-B2 CCL5 inhibitors CCL5, CCL11, CCR5 MEN1 3749/4885KMT2A 4842/4885GAA 2392/4885
US-11318111-B2 CCL5 inhibitors CCL5, CCL11, CCR5 MEN1 3749/4885KMT2A 4842/4885GAA 2392/4885
US-20220409566-A1 CCL5 Inhibitors CCL5, CCL11, CCR5 MEN1 3749/4885KMT2A 4842/4885GAA 2392/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.